Ketcher 11171609032D 1 1.00000 0.00000 0 47 47 0 1 0 999 V2000 23.4112 -4.8761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.4168 -3.8761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.5364 -3.3588 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 24.2877 -3.3842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.2933 -2.3840 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 25.1381 -3.8837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.0090 -3.3920 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 25.1325 -4.8840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.2618 -5.3757 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 25.9979 -5.3923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.8540 -4.8917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.5417 -5.3705 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.8795 -5.3681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8794 -6.3686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7459 -4.8680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6123 -5.3684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7456 -6.8689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6120 -6.3688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4786 -4.8685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3448 -5.3688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4782 -6.8690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3446 -6.3690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2111 -4.8688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0773 -5.3693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2106 -6.8693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9435 -4.8694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.8095 -5.3699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.6758 -4.8700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9438 -3.8692 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.2103 -7.8696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3441 -8.3699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4776 -7.8697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6114 -8.3700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7450 -7.8700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8787 -8.3702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8786 -9.3704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7447 -9.8706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7445 -10.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6106 -11.3709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4768 -10.8709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3427 -11.3710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8782 -11.3707 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.4769 -9.8706 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.9432 -6.8693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9432 -7.8696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0769 -6.3692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0769 -8.3697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 9 1 1 0 0 0 2 3 1 6 0 0 4 2 1 0 0 0 4 5 1 1 0 0 6 4 1 0 0 0 6 7 1 6 0 0 8 6 1 0 0 0 9 8 1 0 0 0 8 10 1 1 0 0 11 10 1 0 0 0 1 12 1 6 0 0 15 13 1 0 0 0 16 15 1 0 0 0 17 14 1 0 0 0 18 17 1 0 0 0 19 16 1 0 0 0 20 19 1 0 0 0 21 18 1 0 0 0 22 21 1 0 0 0 23 20 1 0 0 0 24 23 1 0 0 0 25 22 1 0 0 0 26 24 1 0 0 0 27 26 1 0 0 0 28 27 1 0 0 0 12 28 1 0 0 0 26 29 1 1 0 0 31 30 1 0 0 0 32 31 1 0 0 0 33 32 1 0 0 0 34 33 1 0 0 0 35 34 1 0 0 0 36 35 1 0 0 0 37 36 1 0 0 0 38 37 1 0 0 0 39 38 1 0 0 0 40 39 1 0 0 0 41 40 1 0 0 0 38 42 2 0 0 0 40 43 1 6 0 0 45 44 1 0 0 0 46 44 1 0 0 0 47 45 1 0 0 0 25 46 1 0 0 0 30 47 1 0 0 0 14 13 1 0 0 0 M END > CHEBI:131694 > 1-O-(alpha-D-glucosyl)-29-keto-(3R,31R)-dotriacontanetriol > An α-D-glucoside that is 29-keto-(3R,31R)-dotriacontanetriol having a single α-D-glucosyl residue attached at position 1. > 3 > 1-O-(alpha-D-glucosyl)-29-oxo-(3R,31R)-dotriacontanetriol; 1-O-(alpha-D-glucopyranosyl)-29-keto-(3R,31R)-dotriacontanetriol; (3R,31R)-3,31-dihydroxy-29-oxodotriacontyl alpha-D-glucoside > (3R,31R)-3,31-dihydroxy-29-oxodotriacontyl alpha-D-glucopyranoside > C38H74O9 > 674.990 > 674.53328 > 0 > [C@H]1([C@H](O)[C@@H](O)[C@H](O)[C@H](O1)CO)OCC[C@@H](CCCCCCCCCCCCCCCCCCCCCCCCCC(C[C@@H](C)O)=O)O > InChI=1S/C38H74O9/c1-31(40)29-33(42)26-24-22-20-18-16-14-12-10-8-6-4-2-3-5-7-9-11-13-15-17-19-21-23-25-32(41)27-28-46-38-37(45)36(44)35(43)34(30-39)47-38/h31-32,34-41,43-45H,2-30H2,1H3/t31-,32-,34-,35-,36+,37-,38+/m1/s1 > JDZCCUPQBXSRFJ-ROGCSJSBSA-N > 8182525 > LMFA13010030 $$$$